Mullite
Angel R J, Prewitt C T
American Mineralogist 71 (1986) 1476-1482
Crystal structure of mullite: A re-examination of the average structure
_database_code_amcsd 0001059
7.5785 7.6817 2.8864 90 90 90 Pbam
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Al 0 0 0 .00311 .00266 .01660 .00023 0 0
AlT .14901 .34026 .5 .56 .00255 .00310 .02206 -.00016 0 0
SiT .14901 .34026 .5 .25 .00255 .00310 .02206 -.00016 0 0
AlT* .26247 .20529 .5 .13 .00248 .00326 .01628 .00012 0 0
SiT* .26247 .20529 .5 .06 .00248 .00326 .01628 .00012 0 0
Oab .3590 .4218 .5 .0049 .0063 .0176 -.0024 0 0
Oc .5 0 .5 .39 .0061 .0052 .0609 -.0012 0 0
Oc* .4498 .0505 .5 .19 .0039 .0026 .0386 -.0003 0 0
Od .1273 .2186 0 .0053 .0045 .0308 -.0022 0 0
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Angel R J, McMullan R K, Prewitt C T
American Mineralogist 76 (1991) 332-342
Substructure and superstructure of mullite by neutron diffraction
Model 1 Neutron
_database_code_amcsd 0001351
7.588 7.688 2.8895 90 90 90 Pbam
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Al 0 0 .0 0.0025 0.0017 0.0105 0.0002 0 0
AlT .1490 .3400 .5 .55 0.0017 0.0022 0.0141 -0.0001 0 0
SiT .1490 .3400 .5 .25 0.0017 0.0022 0.0141 -0.0001 0 0
AlT* .2625 .2067 .5 .15 0.0017 0.0021 0.017 -0.0001 0 0
SiT* .2625 .2067 .5 .05 0.0017 0.0021 0.017 -0.0001 0 0
Oab .35838 .42238 .5 0.0044 0.0062 0.0111 -.00285 0 0
Oc .5 0 .5 .40 0.0052 0.0050 0.062 -0.0013 0 0
Oc* .4495 .0509 .5 .20 0.0026 0.0023 0.028 -0.0003 0 0
Od .12733 .21843 0 0.0049 0.0041 0.0258 -.00232 0 0
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Angel R J, McMullan R K, Prewitt C T
American Mineralogist 76 (1991) 332-342
Substructure and superstructure of mullite by neutron diffraction
Model 2 X-ray
_database_code_amcsd 0001352
7.5785 7.6817 2.8864 90 90 90 Pbam
atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Al 0 0 0 0.0024 0.0017 0.0102 0.0002 0 0
SiT1 .148 .3455 .5 .3 0.43
AlT2 .1502 .3362 .5 .5 0.43
AlT* .2622 .2057 .5 .2 0.0008 0.0019 0.012 -0.0002 0 0
Oab1 .3591 .4110 .5 .3 0.41
Oab2 .3509 .4356 .5 .5 0.41
Oab* .3791 .4039 .5 .2 0.41
Oc .5 0 .5 .4 0.0049 0.0043 0.063 -0.0006 0 0
Oc* .4501 .0502 .5 .2 0.0021 0.0016 0.029 -0.0003 0 0
Od .1188 .2259 .024 .3 0.51
Od* .1409 .2067 .020 .2 0.51
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Balzar D, Ledbetter H
American Mineralogist 78 (1993) 1192-1196
Crystal structure and compressibility of 3:2 mullite
_database_code_amcsd 0001618
7.54336 7.69176 2.88402 90 90 90 Pbam
atom x y z occ Biso
Al 0 0 0 .23
Al1 .1485 .3407 .5 .525 .24
Si1 .1485 .3407 .5 .342 .24
Al2 .2610 .2073 .5 .100 .00
Si2 .2610 .2073 .5 .033 .00
O1 .3577 .4235 .5 2.12
O2 .5 0 .5 .475 2.06
O3 .4635 .0465 .5 .198 4.53
O4 .1265 .2197 0 2.16
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Fischer R X, Schneider H, Schmucker M
American Mineralogist 79 (1994) 983-990
Crystal structure of Al-rich mullite
_database_code_amcsd 0001673
7.7391 7.6108 2.9180 90 90 90 Pbam
atom x y z occ Biso
Al 0 0 0 1.93
AlT .1479 .3317 .5 .5 .16
SiT .1479 .3317 .5 .087 .16
Al* .259 .2203 .5 .294 .5
Al** .335 .103 .5 .119 3
Oab .3539 .4209 .5 1.9
Oc .470 .028 .5 .294 4.2
Od .1336 .2164 0 2.9
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Fischer R X, Schneider H
American Mineralogist 85 (2000) 1175-1179
Crystal structure of Cr-mullite
Sample: fixed slit, monochromatic
_database_code_amcsd 0002492
7.56712 7.70909 2.90211 90 90 90 Pbam
atom x y z occ Biso
AlM1 0 0 0 .75 .52
CrM1 0 0 0 .25 .52
AlT .1482 .3416 .5 .5 .69
SiT .1482 .3416 .5 .39 .69
AlT* .2599 .2002 .5 .11 .1
Oab .3565 .4217 .5 1.31
Oc .5 0 .5 1.6
Oc* .4360 .0479 .5 .11 .7
Od .1275 .2249 0 1.26
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Fischer R X, Schmucker M, Angerer P, Schneider H
American Mineralogist 86 (2001) 1513-1518
Crystal structures of Na and K aluminate mullites
Sample: Na
_database_code_amcsd 0002749
7.6819 7.6810 2.91842 90 90 90 Pbam
atom x y z occ Biso
Na .087 .561 1/2 .1675 1.4
Al1 0 0 0 .79
AlT .1510 .3331 1/2 .6675 .83
AlT* .2691 .1956 1/2 .3325 1.1
Oab .3602 .4211 1/2 1.31
Oc* .4843 .0458 1/2 .3325 1.1
Od .1318 .2124 0 1.2
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Fischer R X, Schmucker M, Angerer P, Schneider H
American Mineralogist 86 (2001) 1513-1518
Crystal structures of Na and K aluminate mullites
Sample: K
_database_code_amcsd 0002750
7.6934 7.6727 2.93231 90 90 90 Pbam
atom x y z occ Biso
K 0 1/2 1/2 .335 2.7
Al1 0 0 0 1.02
AlT .1543 .3300 1/2 .6675 .82
AlT* .2678 .1918 1/2 .3325 0.9
Oab .3622 .4178 1/2 1.50
Oc* .4412 .0525 1/2 .3325 0.4
Od .1346 .2078 0 1.2
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Popovic J, Tkalcec E, Grzeta B, Kurajica S, Schmauch J
American Mineralogist 92 (2007) 408-411
Cobalt incorporation in mullite
Sample: MU0
_database_code_amcsd 0004280
7.5520 7.6872 2.8843 90 90 90 Pbam
atom x y z occ Biso
AlM1 0 0 0 .19
AlT .1493 .3406 .5 .50 .36
SiT .1493 .3406 .5 .36 .36
AlT' .264 .204 .5 .14 .43
Oab .3583 .4219 .5 .24
Od .1273 .2201 0 .45
Oc .5 0 .5 .58 1.12
Oc' .452 .044 .5 .14 1.28
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Popovic J, Tkalcec E, Grzeta B, Kurajica S, Schmauch J
American Mineralogist 92 (2007) 408-411
Cobalt incorporation in mullite
Sample: MU1
_database_code_amcsd 0004281
7.5618 7.6882 2.8860 90 90 90 Pbam
atom x y z occ Biso
AlM1 0 0 0 .985 .29
CoM1 0 0 0 .015 .29
AlT .1497 .3398 .5 .4925 .42
SiT .1497 .3398 .5 .3675 .42
AlT' .264 .203 .5 .14 .41
Oab .3581 .4216 .5 .22
Od .1289 .2202 0 .40
Oc .5 0 .5 .58 .85
Oc' .447 .056 .5 .14 1.08
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Voll D, Lengauer C, Beran A, Schneider H
European Journal of Mineralogy 13 (2001) 591-604
Infrared band assignment and structural refinement of
Al-Si, Al-Ge, and Ga-Ge mullites
Sample: Al-Si single-crystal
_database_code_amcsd 0006888
7.5817 7.6813 2.8865 90 90 90 Pbam
atom x y z occ Biso
AlM 0 0 0 .52
AlT .14901 .33994 .5 .5 .57
SiT .14901 .33994 .5 .295 .57
AlT* .2622 .2055 .5 .205 .53
Od .1277 .2181 0 1.11
Oab .3587 .4224 .5 1.03
Oc .5 0 .5 .383 1.8
Oc* .451 .049 .5 .205 .8
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Voll D, Lengauer C, Beran A, Schneider H
European Journal of Mineralogy 13 (2001) 591-604
Infrared band assignment and structural refinement of
Al-Si, Al-Ge, and Ga-Ge mullites
Sample: Al-Si powder data
_database_code_amcsd 0006889
7.5655 7.6883 2.8851 90 90 90 Pbam
atom x y z occ Biso
AlM 0 0 0 .90
AlT .1488 .3408 .5 .5 .97
SiT .1488 .3408 .5 .33 .97
AlT* .2655 .2069 .5 .17 1.2
Od .1262 .2190 0 1.44
Oab .3583 .4223 .5 1.35
Oc .5 0 .5 .49 1.3
Oc* .449 .051 .5 .17 1.4
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Voll D, Lengauer C, Beran A, Schneider H
European Journal of Mineralogy 13 (2001) 591-604
Infrared band assignment and structural refinement of
Al-Si, Al-Ge, and Ga-Ge mullites
Sample: Al-Ge powder data
_database_code_amcsd 0006890
7.6530 7.7779 2.9252 90 90 90 Pbam
atom x y z occ Biso
AlM 0 0 0 .91
AlT .1500 .3391 .5 .5 .98
GeT .1500 .3391 .5 .32 .98
AlT* .2701 .2036 .5 .18 .9
Od .1287 .2128 0 1.42
Oab .3631 .4208 .5 1.42
Oc .5 0 .5 .46 1.7
Oc* .452 .047 .5 .18 1.0
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite
Voll D, Lengauer C, Beran A, Schneider H
European Journal of Mineralogy 13 (2001) 591-604
Infrared band assignment and structural refinement of
Al-Si, Al-Ge, and Ga-Ge mullites
Sample: Ga-Ge powder data
_database_code_amcsd 0006891
7.8674 8.0305 3.0148 90 90 90 Pbam
atom x y z occ Biso
GaM 0 0 0 .85
GaT .1498 .3409 .5 .5 .86
GeT .1498 .3409 .5 .345 .86
GaT* .2676 .2123 .5 .155 1.2
Od .1300 .2163 0 1.4
Oab .3645 .4233 .5 1.2
Oc .5 0 .5 .54 2.6
Oc* .441 .049 .5 .15 3.3
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Mullite-Ge
Saalfeld H, Gerlach H
Zeitschrift fur Kristallographie 195 (1991) 65-73
Solid solution and optical properties of (Al,Ge)-mullites
Locality: synthetic
_database_code_amcsd 0011005
7.644 7.760 2.923 90 90 90 Pbam
atom x y z occ Biso
Al1 0 0 0 .53
Al2 .3499 .1606 .5 .5 .48
Ge2 .3499 .1606 .5 .3086 .48
Al3 .2308 .2966 .5 .1914 .88
O1 .3708 .2875 0 1.06
O2 .1369 .0799 .5 .98
O3 0 .5 .5 .4260 1.03
O4 .0437 .4547 .5 .1914 1.02
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking
Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking
Total number of retrieved datasets: 